3-ethyl-2,2-diphenylphosphirene

C16H15P — CID 150297665

IUPAC3-ethyl-2,2-diphenylphosphirene
SMILESCCC1=PC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H15P/c1-2-15-16(17-15,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2H2,1H3
InChIKeyGIXQMVDJCQXHLA-UHFFFAOYSA-N
MW238.27 g/mol
LogP4.47
Rot. Bonds3

About 3-ethyl-2,2-diphenylphosphirene

3-ethyl-2,2-diphenylphosphirene (PubChem CID 150297665) has the molecular formula C16H15P and a molecular weight of 238.27 g/mol. Its IUPAC name is 3-ethyl-2,2-diphenylphosphirene.

Molecular Properties

Compound Name3-ethyl-2,2-diphenylphosphirene
PubChem CID150297665
Molecular FormulaC16H15P
Molecular Weight238.27 g/mol
Exact Mass238.09
IUPAC Name3-ethyl-2,2-diphenylphosphirene
SMILESCCC1=PC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H15P/c1-2-15-16(17-15,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2H2,1H3
InChIKeyGIXQMVDJCQXHLA-UHFFFAOYSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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1-ethyl-3-methyl-3-phenylazetidine
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1-phenyl-2,2-dipropylcyclopropane-1-carbaldehyde
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1,2,3,4,5,6,7,8,9,10-decakis-phenylhexacyclo[4.4.0.02,5.03,9.04,8.07,10]decane
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sulfanium ethylbenzene
CID 22726309
ethane;ethylbenzene
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CID 158205050
1-ethoxy-4-phenylbicyclo[2.2.2]octane
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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,2-diphenylphosphirene?
The IUPAC name of 3-ethyl-2,2-diphenylphosphirene (CID 150297665) is 3-ethyl-2,2-diphenylphosphirene.
What is the SMILES notation for 3-ethyl-2,2-diphenylphosphirene?
The canonical SMILES for 3-ethyl-2,2-diphenylphosphirene is CCC1=PC1(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-ethyl-2,2-diphenylphosphirene?
The InChIKey is GIXQMVDJCQXHLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15P/c1-2-15-16(17-15,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2H2,1H3.
What are the key properties of 3-ethyl-2,2-diphenylphosphirene?
3-ethyl-2,2-diphenylphosphirene has a molecular weight of 238.27 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,2-diphenylphosphirene is sourced from PubChem (CID 150297665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).